4-cyclohexyl-5-(4-methoxyphenyl)-2-[(morpholin-4-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
4-cyclohexyl-5-(4-methoxyphenyl)-2-[(morpholin-4-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
4-cyclohexyl-5-(4-methoxyphenyl)-2-[(morpholin-4-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | IB09-4151 |
| Compound Name: | 4-cyclohexyl-5-(4-methoxyphenyl)-2-[(morpholin-4-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 388.53 |
| Molecular Formula: | C20 H28 N4 O2 S |
| Smiles: | COc1ccc(cc1)C1=NN(CN2CCOCC2)C(N1C1CCCCC1)=S |
| Stereo: | ACHIRAL |
| logP: | 3.57 |
| logD: | 3.56 |
| logSw: | -3.77 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 123.73 |
| InChI Key: | RHAVADWBUCMPNS-UHFFFAOYSA-N |